IOData: A python library for reading, writing, and converting computational chemistry file formats and generating input files. - Toon Verstraelen; William Adams; Leila Pujal; Alireza Tehrani; Braden D. Kelly; Luis Macaya; Fanwang Meng; Michael Richer; Raymundo Hernández-Esparza; Xiaotian Derrick Yang; Matthew Chan; Taewon David Kim; et al. (J. Comput. Chem., 2021)

Procrustes: A python library to find transformations that maximize the similarity between matrices. - Fanwang Meng; Michael Richer; Alireza Tehrani; Jonathan La; Taewon David Kim; Paul W. Ayers; Farnaz Heidar-Zadeh (Comput. Phys. Commun., 2022)

Extended continuous similarity indices: theory and application for QSAR descriptor selection. - Anita Rácz; Timothy B. Dunn; Dávid Bajusz; Taewon David Kim; Ramón Alain Miranda-Quintana; Károly Héberger (J. Comput. Aided Mol. Des., 2022)

Diversity and Chemical Library Networks of Large Data Sets. - Timothy B. Dunn; Gustavo de M. Seabra; Taewon David Kim; K. Eurídice Juárez-Mercado; Chenglong Li; José L. Medina-Franco; Ramón Alain Miranda-Quintana (J. Chem. Inf. Model., 2022)

Fanpy: A python library for prototyping multideterminant methods in ab initio quantum chemistry. - Taewon David Kim; Michael Richer; Gabriela Sánchez-Díaz; Ramón Alain Miranda-Quintana; Toon Verstraelen; Farnaz Heidar-Zadeh; Paul W. Ayers (J. Comput. Chem., 2023)